3-[butyl-[(4-chlorophenyl)methyl]amino]benzoic acid

Systemtic Name: 3-[butyl-[(4-chlorophenyl)methyl]amino]benzoic acid Openeye Name: 3-[butyl-[(4-chlorophenyl)methyl]amino]benzoic acid CAS Name: 3-[butyl-[(4-chlorophenyl)methyl]amino]benzoic acid IUPAC Name: 3-[butyl-[(4-chlorophenyl)methyl]amino]benzoic acid Traditional Name: 3-[butyl-(4-chlorobenzyl)amino]benzoic acid Formula: C18H20ClNO2 MolecularWeight: 317.8099

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Descriptors Computed from Structure

Canonical SMILES:

CCCCN(CC1=CC=C(C=C1)Cl)C2=CC=CC(=C2)C(=O)O

Isomeric SMILES

CCCCN(CC1=CC=C(C=C1)Cl)C2=CC=CC(=C2)C(=O)O

InChI

InChI=1S/C18H20ClNO2/c1-2-3-11-20(13-14-7-9-16(19)10-8-14)17-6-4-5-15(12-17)18(21)22/h4-10,12H,2-3,11,13H2,1H3,(H,21,22)